COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL447247
Chemical Name: 5-cyclohexyl-1-hydroxy-6-methyl-3-thioxo-3,5-dihydro-4H-pyrrolo[3,4-c]pyridin-4-one
Smiles: S=C1N=C(c2c1c(=O)n(c(c2)C)C1CCCCC1)O

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Molecular Weight: 276.36
Empirical Formula: C14H16N2O2S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 1.812
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 3

     

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